Attributes
UniProt ID
Protein Name
DNA gyrase subunit B
Ligand Name
~{N}-[(1~{R})-2-azanyl-1-phenyl-ethyl]-4-(1~{H}-pyrrolo[2,3-b]pyridin-3-yl)thiophene-2-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ZNBOMXQVNVLXCZ-KRWDZBQOSA-N
SMILES
c1ccc(cc1)C(CN)NC(=O)c2cc(cs2)c3c[nH]c4c3cccn4
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5NPK
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Color Legend
Unassigned regionsLigand / hetero atomse5npkB1e5npkB2e5npkB3e5npkB4e5npkD1e5npkD2e5npkD3e5npkD4e5npkb2e5npkb3e5npkb4e5npkb5e5npkd1e5npkd2e5npkd3e5npkd4
ECOD domains from experimental PDB structures interacting with ligand 94H
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P66937 | n/a | 94H | 5npk | e5npkB2 | B:1328-1491 |
| P66937 | n/a | 94H | 5npk | e5npkD1 | D:1328-1491 |
| P66937 | n/a | 94H | 5npk | e5npkD2 | D:1144-1327 |
| P66937 | n/a | 94H | 5npk | e5npkD3 | D:417-637 |
| P66937 | n/a | 94H | 5npk | e5npkD4 | D:638-1143 |
| P66937 | n/a | 94H | 5npk | e5npkb2 | b:417-637 |
| P66937 | n/a | 94H | 5npk | e5npkb4 | b:1328-1490 |
| P66937 | n/a | 94H | 5npk | e5npkd1 | d:638-1143 |
| P66937 | n/a | 94H | 5npk | e5npkd2 | d:417-637 |
| P66937 | n/a | 94H | 5npk | e5npkd3 | d:1328-1491 |
| P66937 | n/a | 94H | 5npk | e5npkd4 | d:1144-1327 |